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1198-14-7 | 8-Quinolinol, 5-bromo-
CAS No: 1198-14-7 Catalog No: AG000PO3 MDL No:MFCD00457011
Product Description
Catalog Number:
AG000PO3
Chemical Name:
8-Quinolinol, 5-bromo-
CAS Number:
1198-14-7
Molecular Formula:
C9H6BrNO
Molecular Weight:
224.0540
MDL Number:
MFCD00457011
IUPAC Name:
5-bromoquinolin-8-ol
InChI:
InChI=1S/C9H6BrNO/c10-7-3-4-8(12)9-6(7)2-1-5-11-9/h1-5,12H
InChI Key:
WIIUANWSGSTCLG-UHFFFAOYSA-N
SMILES:
Brc1ccc(c2c1cccn2)O
EC Number:
214-829-2
NSC Number:
74941
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.963g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.057g/mol
Monoisotopic Mass:
222.963g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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